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Information card for entry 2311232
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Coordinates | 2311232.cif |
---|---|
Original IUCr paper | HTML |
Chemical name | <i>N</i>'-[(<i>E</i>)-2-Chlorobenzylidene]-2-(6-methoxynaphthalen-2-yl)propanohydrazide |
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Formula | C21 H19 Cl N2 O2 |
Calculated formula | C21 H19 Cl N2 O2 |
SMILES | Clc1c(/C=N/NC(=O)[C@H](c2cc3ccc(OC)cc3cc2)C)cccc1 |
Title of publication | N'-[(E)-2-Chloro-benzyl-idene]-2-(6-meth-oxy-naphthalen-2-yl)propano-hydrazide. |
Authors of publication | Mague, Joel T.; Mohamed, Shaaban K.; Akkurt, Mehmet; Potgieter, Herman; Albayati, Mustafa R. |
Journal of publication | Acta crystallographica. Section E, Structure reports online |
Year of publication | 2014 |
Journal volume | 70 |
Journal issue | Pt 6 |
Pages of publication | o631 - 2 |
a | 6.5703 ± 0.0002 Å |
b | 8.6166 ± 0.0002 Å |
c | 16.3411 ± 0.0004 Å |
α | 90° |
β | 98.685 ± 0.0009° |
γ | 90° |
Cell volume | 914.52 ± 0.04 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0276 |
Residual factor for significantly intense reflections | 0.026 |
Weighted residual factors for significantly intense reflections | 0.0625 |
Weighted residual factors for all reflections included in the refinement | 0.0635 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.053 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/2311232.html
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